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59311-79-4 | 4H,5H,6H,7H-thieno[3,2-c]pyridine-4-thione
CAS No: 59311-79-4 Catalog No: AG01B6R4 MDL No:MFCD20673049
Product Description
Catalog Number:
AG01B6R4
Chemical Name:
4H,5H,6H,7H-thieno[3,2-c]pyridine-4-thione
CAS Number:
59311-79-4
Molecular Formula:
C7H7NS2
Molecular Weight:
169.2672
MDL Number:
MFCD20673049
IUPAC Name:
6,7-dihydro-5H-thieno[3,2-c]pyridine-4-thione
InChI:
InChI=1S/C7H7NS2/c9-7-5-2-4-10-6(5)1-3-8-7/h2,4H,1,3H2,(H,8,9)
InChI Key:
KNZZPOCBQJOFMU-UHFFFAOYSA-N
SMILES:
S=C1NCCc2c1ccs2
Properties
Complexity:
158
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.002g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
169.26g/mol
Monoisotopic Mass:
169.002g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
72.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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